orbital_charges     :real:2:4,4
  0.750241694317563E+000  0.686062480458312E+000  0.686062480458312E+000
  0.686062480458312E+000  0.397190288102501E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.397190288102500E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.397190288102501E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000
forces              :real:2:3,4
 -0.502389693983300E-005  0.502389694037684E-005 -0.502389694042541E-005
 -0.150511611620171E-002 -0.301525612934336E-002 -0.150511611620143E-002
  0.301525612934322E-002  0.150511611620151E-002 -0.150511611620155E-002
 -0.150511611620170E-002  0.150511611620149E-002  0.301525612934338E-002
mermin_energy       :real:0:
 -0.262800575411083E+001
end_coords          :real:2:3,4
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
 -0.838771528516714E+000 -0.167677854948749E+001 -0.838771528516714E+000
  0.167677854948749E+001  0.838771528516714E+000 -0.838771528516714E+000
 -0.838771528516714E+000  0.838771528516714E+000  0.167677854948749E+001
